6-(azepane-1-sulfonyl)-4-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-4-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2H-1,4-benzothiazin-3(4H)-one
6-(azepane-1-sulfonyl)-4-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | G549-0123 |
| Compound Name: | 6-(azepane-1-sulfonyl)-4-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 484.6 |
| Molecular Formula: | C23 H24 N4 O4 S2 |
| Smiles: | C1CCCN(CC1)S(c1ccc2c(c1)N(CC1=CC(N3C=CC=CC3=N1)=O)C(CS2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5569 |
| logD: | 2.5569 |
| logSw: | -2.8449 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 73.647 |
| InChI Key: | DOFFITUKBHSJRG-UHFFFAOYSA-N |